4-[(4-methoxyphenoxy)methyl]-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidine

C18H25N3O2 — CID 74236528

IUPAC4-[(4-methoxyphenoxy)methyl]-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidine
SMILESCOc1ccc(OCC2CCN(Cc3cnc(C)[nH]3)CC2)cc1
InChIInChI=1S/C18H25N3O2/c1-14-19-11-16(20-14)12-21-9-7-15(8-10-21)13-23-18-5-3-17(22-2)4-6-18/h3-6,11,15H,7-10,12-13H2,1-2H3,(H,19,20)
InChIKeyGOLMMRKJQKITIX-UHFFFAOYSA-N
MW315.42 g/mol
LogP3.02
Rot. Bonds6

About 4-[(4-methoxyphenoxy)methyl]-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidine

4-[(4-methoxyphenoxy)methyl]-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidine (PubChem CID 74236528) has the molecular formula C18H25N3O2 and a molecular weight of 315.42 g/mol. Its IUPAC name is 4-[(4-methoxyphenoxy)methyl]-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidine.

Molecular Properties

Compound Name4-[(4-methoxyphenoxy)methyl]-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidine
PubChem CID74236528
Molecular FormulaC18H25N3O2
Molecular Weight315.42 g/mol
Exact Mass315.19
IUPAC Name4-[(4-methoxyphenoxy)methyl]-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidine
SMILESCOc1ccc(OCC2CCN(Cc3cnc(C)[nH]3)CC2)cc1
InChIInChI=1S/C18H25N3O2/c1-14-19-11-16(20-14)12-21-9-7-15(8-10-21)13-23-18-5-3-17(22-2)4-6-18/h3-6,11,15H,7-10,12-13H2,1-2H3,(H,19,20)
InChIKeyGOLMMRKJQKITIX-UHFFFAOYSA-N
XLogP3.02
TPSA50.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.42
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(1H-Imidazol-4-yl)propyl 4-methoxyphenyl ether
CID 10681081
4-(3-Phenoxy-propyl)-1H-imidazole with (0.95M)oxalic acid
CID 10774476
4-[3-(4-Butyl-phenoxy)-propyl]-1H-imidazole
CID 21193574
1-(3-(3-(4-((1H-imidazol-4-yl)methyl)piperidin-1-yl)propoxy)benzyl)piperidine
CID 44408021
1-(4-((1H-imidazol-4-yl)methyl)piperidin-1-yl)-3-phenoxypropan-1-one
CID 9861608
4-((1H-imidazol-4-yl)methyl)-1-(3-phenoxypropyl)piperidine
CID 9948238
1-(4-(3-(4-((1H-imidazol-4-yl)methyl)piperidin-1-yl)propoxy)benzyl)piperidine
CID 10475883
4-[2-(4-Methoxyphenoxy)ethyl]-1H-imidazole
CID 10822681
4-(3-m-Tolyloxy-propyl)-1H-imidazole
CID 11264399
N-(1H-imidazol-5-ylmethyl)-4-methoxy-N-propan-2-ylaniline
CID 59728062
ethyl 1-[(2-methyl-1H-imidazol-4-yl)methyl]-4-(2-phenoxyethyl)piperidine-4-carboxylate
CID 16189167
4-((1H-imidazol-4-yl)methyl)-1-(3-(3-chlorophenoxy)propyl)piperidine
CID 44406392

Frequently Asked Questions

What is the IUPAC name of 4-[(4-methoxyphenoxy)methyl]-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidine?
The IUPAC name of 4-[(4-methoxyphenoxy)methyl]-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidine (CID 74236528) is 4-[(4-methoxyphenoxy)methyl]-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidine.
What is the SMILES notation for 4-[(4-methoxyphenoxy)methyl]-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidine?
The canonical SMILES for 4-[(4-methoxyphenoxy)methyl]-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidine is COc1ccc(OCC2CCN(Cc3cnc(C)[nH]3)CC2)cc1.
What is the InChIKey of 4-[(4-methoxyphenoxy)methyl]-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidine?
The InChIKey is GOLMMRKJQKITIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O2/c1-14-19-11-16(20-14)12-21-9-7-15(8-10-21)13-23-18-5-3-17(22-2)4-6-18/h3-6,11,15H,7-10,12-13H2,1-2H3,(H,19,20).
What are the key properties of 4-[(4-methoxyphenoxy)methyl]-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidine?
4-[(4-methoxyphenoxy)methyl]-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidine has a molecular weight of 315.42 g/mol, XLogP of 3.02, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-methoxyphenoxy)methyl]-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidine is sourced from PubChem (CID 74236528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).